1,3,4,5,7,9,10,11,13,15,16,17-Dodecahydrodibenzo[b,j]quinolino[2,3-f][1,7]phenanthroline-6,12,18(2H,8H,14H)-trione
TL;DR: 1,3,4,5,7,9,10,11,13,15,16,17-Dodecahydrodibenzo[b,j]quinolino[2,3-f][1,7]phenanthroline-6,12,18(2H,8H,14H)-trione (CAS 70071-68-0) is a chemical compound with molecular formula C27H27N3O3 and molecular weight 441.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,13,23-triazaheptacyclo[20.8.0.02,11.04,9.012,21.014,19.024,29]triaconta-1,4(9),11,14(19),21,24(29)-hexaene-10,20,30-trione
Also Known As: 1,3,4,5,7,9,10,11,13,15,16,17-Dodecahydrodibenzo[b,j]quinolino[2,3-f][1,7]phenanthroline-6,12,18(2H,8H,14H)-trione, 3,13,23-Triazaheptacyclo[20.8.0.02,11.04,9.012,21.014,19.024,29]triaconta-1,4(9),11,14(19),21,24(29)-hexaene-10,20,30-trione
| Molecular Formula | C27H27N3O3 |
|---|---|
| Molecular Weight | 441.21 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 87.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 441.20523 |
| Heavy Atoms | 33 |
| Complexity | 927.0 |
Chemical Identifiers
| CAS Number | 70071-68-0 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=O)C3=C4C(=C5C(=C3N2)C(=O)C6=C(N5)CCCC6)C(=O)C7=C(N4)CCCC7 |
| InChIKey | NDEOWZRFMBOVCQ-UHFFFAOYSA-N |
Product Overview
1,3,4,5,7,9,10,11,13,15,16,17-Dodecahydrodibenzo[b,j]quinolino[2,3-f][1,7]phenanthroline-6,12,18(2H,8H,14H)-trione (CAS 70071-68-0), with molecular formula C27H27N3O3 and molecular weight 441.21 g/mol. IUPAC: 3,13,23-triazaheptacyclo[20.8.0.02,11.04,9.012,21.014,19.024,29]triaconta-1,4(9),11,14(19),21,24(29)-hexaene-10,20,30-trione.
Chemical Property Profile of 1,3,4,5,7,9,10,11,13,15,16,17-Dodecahydrodibenzo[b,j]quinolino[2,3-f][1,7]phenanthroline-6,12,18(2H,8H,14H)-trione
Property Insights of 1,3,4,5,7,9,10,11,13,15,16,17-Dodecahydrodibenzo[b,j]quinolino[2,3-f][1,7]phenanthroline-6,12,18(2H,8H,14H)-trione
The XLogP value of 4.5 indicates that 1,3,4,5,7,9,10,11,13,15,16,17-Dodecahydrodibenzo[b,j]quinolino[2,3-f][1,7]phenanthroline-6,12,18(2H,8H,14H)-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,4,5,7,9,10,11,13,15,16,17-Dodecahydrodibenzo[b,j]quinolino[2,3-f][1,7]phenanthroline-6,12,18(2H,8H,14H)-trione. Following Lipinski's Rule of Five, 1,3,4,5,7,9,10,11,13,15,16,17-Dodecahydrodibenzo[b,j]quinolino[2,3-f][1,7]phenanthroline-6,12,18(2H,8H,14H)-trione has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3,4,5,7,9,10,11,13,15,16,17-Dodecahydrodibenzo[b,j]quinolino[2,3-f][1,7]phenanthroline-6,12,18(2H,8H,14H)-trione?
The CAS number of 1,3,4,5,7,9,10,11,13,15,16,17-Dodecahydrodibenzo[b,j]quinolino[2,3-f][1,7]phenanthroline-6,12,18(2H,8H,14H)-trione is 70071-68-0.
What is the molecular formula of 1,3,4,5,7,9,10,11,13,15,16,17-Dodecahydrodibenzo[b,j]quinolino[2,3-f][1,7]phenanthroline-6,12,18(2H,8H,14H)-trione?
The molecular formula of 1,3,4,5,7,9,10,11,13,15,16,17-Dodecahydrodibenzo[b,j]quinolino[2,3-f][1,7]phenanthroline-6,12,18(2H,8H,14H)-trione is C27H27N3O3.
What is the molecular weight of 1,3,4,5,7,9,10,11,13,15,16,17-Dodecahydrodibenzo[b,j]quinolino[2,3-f][1,7]phenanthroline-6,12,18(2H,8H,14H)-trione?
The molecular weight of 1,3,4,5,7,9,10,11,13,15,16,17-Dodecahydrodibenzo[b,j]quinolino[2,3-f][1,7]phenanthroline-6,12,18(2H,8H,14H)-trione is 441.21 g/mol.
Where can I buy 1,3,4,5,7,9,10,11,13,15,16,17-Dodecahydrodibenzo[b,j]quinolino[2,3-f][1,7]phenanthroline-6,12,18(2H,8H,14H)-trione?
You can request a quote for 1,3,4,5,7,9,10,11,13,15,16,17-Dodecahydrodibenzo[b,j]quinolino[2,3-f][1,7]phenanthroline-6,12,18(2H,8H,14H)-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,4,5,7,9,10,11,13,15,16,17-Dodecahydrodibenzo[b,j]quinolino[2,3-f][1,7]phenanthroline-6,12,18(2H,8H,14H)-trione?
Yes, KEHONG BIO provides custom synthesis services for 1,3,4,5,7,9,10,11,13,15,16,17-Dodecahydrodibenzo[b,j]quinolino[2,3-f][1,7]phenanthroline-6,12,18(2H,8H,14H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.